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J9WwBlx1nS3
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J9WwBlx1nS3
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9-Phenanthrenamine, N-(cyclopropylmethyl)-4b,5,6,7,8,8a,9,10-octahydro-3-methoxy-4b-methyl-, (4b.alpha.,8a.alpha.,9.beta.)-(.+-.)-
SpectraBase Compound ID BoUSGs055G8
InChI InChI=1S/C20H29NO/c1-20-10-4-3-5-17(20)19(21-13-14-6-7-14)11-15-8-9-16(22-2)12-18(15)20/h8-9,12,14,17,19,21H,3-7,10-11,13H2,1-2H3/t17-,19-,20-/m0/s1
InChIKey HCZRTXJGPHBLKE-IHPCNDPISA-N
Mol Weight 299.46 g/mol
Molecular Formula C20H29NO
Exact Mass 299.224915 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J9WwBlx1nS3
Name 9-Phenanthrenamine, N-(cyclopropylmethyl)-4b,5,6,7,8,8a,9,10-octahydro-3-methoxy-4b-methyl-, (4b.alpha.,8a.alpha.,9.beta.)-(.+-.)-
CAS Registry Number 94272-72-7
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H29NO
InChI InChI=1S/C20H29NO/c1-20-10-4-3-5-17(20)19(21-13-14-6-7-14)11-15-8-9-16(22-2)12-18(15)20/h8-9,12,14,17,19,21H,3-7,10-11,13H2,1-2H3/t17-,19-,20-/m0/s1
InChIKey HCZRTXJGPHBLKE-IHPCNDPISA-N
Molecular Weight 299.458 g/mol
SMILES N([C@@]1([C@]2([C@](c3c(ccc(c3)OC)C1)(C)CCCC2)[H])[H])CC1CC1
SPLASH splash10-0a4i-9160000000-655b500647e67ed1c949
Source of Spectrum H-67-1601-0
Synonyms (4bS,8aR,9S)-N-(cyclopropylmethyl)-3-methoxy-4b-methyl-4b,5,6,7,8,8a,9,10-octahydro-9-phenanthrenamine N-Cyclopropylmethyl-3-methoxy-4b,n-dimethyl-cis-4b,5,6,7,8,8a,9,10-octahydrophenanthren-9-amine (isomer a) N-Cyclopropylmethyl-3-methoxy-4b,n-dimethyl-cis-4b,5,6,7,8,8a,9,10-octahydrophenanthren-9-amine (isomer b) N-[(4bS,8aR,9S)-3-methoxy-4b-methyl-4b,5,6,7,8,8a,9,10-octahydro-9-phenanthrenyl]-N-(cyclopropylmethyl)amine
Wiley ID 1302253
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